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1-O-(BETA-D-GLUCOPYRANOSYLOXY)-(2-S,3-R,4-R,8-Z)-2-[(2'-R)-2'-HYDROXYTRICOSANOYLAMINO]-8-NOADECENE-3,4-DIOL
SpectraBase Compound ID 2tLlAqPwg2M
InChI InChI=1S/C48H93NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-41(52)47(57)49-39(38-58-48-46(56)45(55)44(54)42(37-50)59-48)43(53)40(51)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h27,29,39-46,48,50-56H,3-26,28,30-38H2,1-2H3,(H,49,57)/b29-27+
InChIKey YDXLBYDQHCMQBS-ORIPQNMZSA-N
Mol Weight 844.3 g/mol
Molecular Formula C48H93NO10
Exact Mass 843.679948 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H5ciiYf6RND
Name 1-O-(BETA-D-GLUCOPYRANOSYLOXY)-(2-S,3-R,4-R,8-Z)-2-[(2'-R)-2'-HYDROXYTRICOSANOYLAMINO]-8-NOADECENE-3,4-DIOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H93NO10
InChI InChI=1S/C48H93NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-41(52)47(57)49-39(38-58-48-46(56)45(55)44(54)42(37-50)59-48)43(53)40(51)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h27,29,39-46,48,50-56H,3-26,28,30-38H2,1-2H3,(H,49,57)/b29-27+
InChIKey YDXLBYDQHCMQBS-ORIPQNMZSA-N
Literature Reference Author W.W.TAO,N.Y.YANG,L.LIU,J.A.DUAN,D.K.WU,D.W.QIAN,Y.P.TANG
Literature Reference Citation FITOTERAPIA,81,196(2010)
Literature Reference DOI 10.1016/j.fitote.2009.08.026
Molecular Weight 844.267 g/mol
Solvent DMSO-D6
Source File Reference UWMZ47743